1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide

C16H31N3O2 — CID 71024381

IUPAC1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide
SMILESCCCN(C(=O)C1CCCN1CCOC)C1CCNCC1
InChIInChI=1S/C16H31N3O2/c1-3-10-19(14-6-8-17-9-7-14)16(20)15-5-4-11-18(15)12-13-21-2/h14-15,17H,3-13H2,1-2H3
InChIKeyUGFXKRIVDCGVJI-UHFFFAOYSA-N
MW297.44 g/mol
LogP1.09
Rot. Bonds7

About 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide

1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide (PubChem CID 71024381) has the molecular formula C16H31N3O2 and a molecular weight of 297.44 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide
PubChem CID71024381
Molecular FormulaC16H31N3O2
Molecular Weight297.44 g/mol
Exact Mass297.24
IUPAC Name1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide
SMILESCCCN(C(=O)C1CCCN1CCOC)C1CCNCC1
InChIInChI=1S/C16H31N3O2/c1-3-10-19(14-6-8-17-9-7-14)16(20)15-5-4-11-18(15)12-13-21-2/h14-15,17H,3-13H2,1-2H3
InChIKeyUGFXKRIVDCGVJI-UHFFFAOYSA-N
XLogP1.09
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.44
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide (CID 71024381) is 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide is CCCN(C(=O)C1CCCN1CCOC)C1CCNCC1.
What is the InChIKey of 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide?
The InChIKey is UGFXKRIVDCGVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O2/c1-3-10-19(14-6-8-17-9-7-14)16(20)15-5-4-11-18(15)12-13-21-2/h14-15,17H,3-13H2,1-2H3.
What are the key properties of 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide?
1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide has a molecular weight of 297.44 g/mol, XLogP of 1.09, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-N-piperidin-4-yl-N-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 71024381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).